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ジャーナル論文(5)
キーワード
density functional theory (5)
Al-Nb-Ni (1)
CALPHAD (1)
SQS (1)
Solar cells (1)
carrier transport (1)
cerium dioxide (1)
defect (1)
electron paramagnetic resonance (1)
epitaxial film (1)
(more)
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キーワード: density functional theory
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5 件のレコードが見つかりました。
First-principles thermodynamic modeling for the Al-Nb-Ni ternary system
ジャーナル論文
著者
Arkapol Saengdeejing
(author) (
この著者で検索
)
https://orcid.org/0000-0001-8739-3262
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Arkapol Saengdeejing
;
Ryoji Sahara
(author) (
この著者で検索
)
https://orcid.org/0000-0003-0788-2985
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Ryoji Sahara
;
Yoshiaki Toda
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8343-2890
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Yoshiaki Toda
キーワード
CALPHAD
,
density functional theory
,
SQS
,
first principles
,
thermodynamic database
,
Al-Nb-Ni
刊行年月日
2024-12-31
更新時刻
2024-12-05 12:47:48 +0900
Point defects in BaSi2 identified and analyzed by electron paramagnetic resonance, photoluminescence and density functional theory
ジャーナル論文
著者
Takuma Sato
(author) (
この著者で検索
)
Takuma Sato
;
Jean-Marie Mouesca
(author) (
この著者で検索
)
Jean-Marie Mouesca
;
Anne-Laure Barra
(author) (
この著者で検索
)
Anne-Laure Barra
;
Didier Gourier
(author) (
この著者で検索
)
Didier Gourier
;
Motoharu Imai
(author) (
この著者で検索
)
https://orcid.org/0000-0002-5848-113X
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Motoharu Imai
;
Takashi Suemasu
(author) (
この著者で検索
)
Takashi Suemasu
;
Serge Gambarelli
(author) (
この著者で検索
)
Serge Gambarelli
キーワード
silicide
,
semiconductor
,
point defects
,
electron paramagnetic resonance
,
density functional theory
刊行年月日
2024-07-29
更新時刻
2024-08-26 12:30:40 +0900
Near-surface defects break symmetry in water adsorption on CeO2−x(111)
ジャーナル論文
著者
Oscar Custance
(author) (
この著者で検索
)
https://orcid.org/0000-0001-7931-603X
NIMS Researchers Directory SAMURAI
Oscar Custance
;
Manuel González Lastre
(author) (
この著者で検索
)
https://orcid.org/0009-0000-2299-6687
(unauthenticated)
Manuel González Lastre
;
Kyungmin Kim
(author) (
この著者で検索
)
https://orcid.org/0000-0002-3147-5100
(unauthenticated)
Kyungmin Kim
;
Estefanía Fernández-Villanueva
(author) (
この著者で検索
)
https://orcid.org/0000-0002-9419-0786
(unauthenticated)
Estefanía Fernández-Villanueva
;
Pablo Pou
(author) (
この著者で検索
)
https://orcid.org/0000-0002-5854-8218
(unauthenticated)
Pablo Pou
;
Masayuki Abe
(author) (
この著者で検索
)
https://orcid.org/0000-0001-5619-3911
(unauthenticated)
Masayuki Abe
;
Hossein Sepehri-Amin
(author) (
この著者で検索
)
https://orcid.org/0000-0002-7856-7897
NIMS Researchers Directory SAMURAI
Hossein Sepehri-Amin
;
Shigeki Kawai
(author) (
この著者で検索
)
https://orcid.org/0000-0003-2128-0120
NIMS Researchers Directory SAMURAI
Shigeki Kawai
;
M. Verónica Ganduglia-Pirovano
(author) (
この著者で検索
)
https://orcid.org/0000-0003-2408-8898
(unauthenticated)
M. Verónica Ganduglia-Pirovano
;
Ruben Perez
(author) (
この著者で検索
)
https://orcid.org/0000-0001-5896-541X
(unauthenticated)
Ruben Perez
キーワード
scanning probe microscopy
,
cerium dioxide
,
water
,
surface
,
thin films
,
density functional theory
刊行年月日
2026-01-23
更新時刻
2026-02-08 08:30:20 +0900
Nanoscale Origin of Strong Charge Carrier Scattering at Grain Boundaries in Orthorhombic SnSe Semiconductor Thin Films
ジャーナル論文
著者
Xinyi He
(author) (
この著者で検索
)
Xinyi He
;
Kenji Matsuo
(author) (
この著者で検索
)
Kenji Matsuo
;
Takayoshi Katase
(author) (
この著者で検索
)
https://orcid.org/0000-0002-2593-7487
(unauthenticated)
Takayoshi Katase
;
Kota Hanzawa
(author) (
この著者で検索
)
https://orcid.org/0000-0002-0995-9360
(unauthenticated)
Kota Hanzawa
;
Hideto Yoshida
(author) (
この著者で検索
)
Hideto Yoshida
;
Shigenori Ueda
(author) (
この著者で検索
)
https://orcid.org/0000-0001-9425-0614
NIMS Researchers Directory SAMURAI
Shigenori Ueda
;
Hidenori Hiramatsu
(author) (
この著者で検索
)
https://orcid.org/0000-0002-5664-5831
(unauthenticated)
Hidenori Hiramatsu
;
Hideo Hosono
(author) (
この著者で検索
)
https://orcid.org/0000-0001-9260-6728
NIMS Researchers Directory SAMURAI
Hideo Hosono
;
Toshio Kamiya
(author) (
この著者で検索
)
Toshio Kamiya
キーワード
tin selenide
,
thermoelectric material
,
epitaxial film
,
carrier transport
,
defect
,
density functional theory
刊行年月日
2025-04-25
更新時刻
2025-05-15 08:38:54 +0900
Computational material screening for electrode materials of BaSi2 solar cells
ジャーナル論文
著者
Tomoaki Yazaki
(author) (
この著者で検索
)
University of Yamanashi a Center for Crystal Science and Technology
Tomoaki Yazaki
;
Keisuke Arimoto
(author) (
この著者で検索
)
Keisuke Arimoto
;
Junji Yamanaka
(author) (
この著者で検索
)
Junji Yamanaka
;
Kosuke O. Hara
(author) (
この著者で検索
)
Kosuke O. Hara
キーワード
Solar cells
,
metallic electrode
,
high-throughput virtual screening
,
work function
,
melting point
,
density functional theory
刊行年月日
2026-12-31
更新時刻
2026-03-07 12:30:04 +0900
キーワード
density functional theory
(5)
Al-Nb-Ni
(1)
CALPHAD
(1)
SQS
(1)
Solar cells
(1)
carrier transport
(1)
cerium dioxide
(1)
defect
(1)
electron paramagnetic resonance
(1)
epitaxial film
(1)
first principles
(1)
high-throughput virtual screening
(1)
melting point
(1)
metallic electrode
(1)
point defects
(1)
scanning probe microscopy
(1)
semiconductor
(1)
silicide
(1)
surface
(1)
thermodynamic database
(1)
thermoelectric material
(1)
thin films
(1)
tin selenide
(1)
water
(1)
work function
(1)
RDEメタデータ定義
RDE送り状
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